5LU1
Human 14-3-3 sigma CLU3 mutant complexed with short HSPB6 phosphopeptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 2 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-06-12 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9801 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 55.610, 104.010, 123.070 |
Unit cell angles | 90.00, 93.89, 90.00 |
Refinement procedure
Resolution | 47.890 - 2.400 |
R-factor | 0.186 |
Rwork | 0.184 |
R-free | 0.21400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3iqj |
RMSD bond length | 0.010 |
RMSD bond angle | 1.640 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | BUSTER-TNT (2.10.3) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.000 | 2.460 | |
High resolution limit [Å] | 2.400 | 10.730 | 2.400 |
Rmerge | 0.099 | 0.032 | 1.533 |
Number of reflections | 54513 | ||
<I/σ(I)> | 8.61 | 25.94 | 0.9 |
Completeness [%] | 99.6 | 96.6 | 99.9 |
Redundancy | 3.7 | ||
CC(1/2) | 0.997 | 0.997 | 0.311 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.1 M Bis-Tris propane (pH 6.5), 0.2 M NaNO3 and 20% PEG 3350 |